6-[[4,6-bis(oxidanylidene)-1H-pyrimidin-2-yl]amino]hexanoic acid; ethanoic acid

Systemtic Name: 6-[[4,6-bis(oxidanylidene)-1H-pyrimidin-2-yl]amino]hexanoic acid; ethanoic acid Openeye Name: acetic acid; 6-[(4,6-dioxo-1H-pyrimidin-2-yl)amino]hexanoic acid CAS Name: acetic acid; 6-[(4,6-dioxo-1H-pyrimidin-2-yl)amino]hexanoic acid IUPAC Name: acetic acid; 6-[(4,6-dioxo-1H-pyrimidin-2-yl)amino]hexanoic acid Traditional Name: acetic acid; 6-[(4,6-diketo-1H-pyrimidin-2-yl)amino]hexanoic acid Formula: C12H19N3O6 MolecularWeight: 301.29576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1C(=O)NC(=NC1=O)NCCCCCC(=O)O

Isomeric SMILES

CC(=O)O.C1C(=O)NC(=NC1=O)NCCCCCC(=O)O

InChI

InChI=1S/C10H15N3O4.C2H4O2/c14-7-6-8(15)13-10(12-7)11-5-3-1-2-4-9(16)17;1-2(3)4/h1-6H2,(H,16,17)(H2,11,12,13,14,15);1H3,(H,3,4)